Enisoprost

methyl (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]hept-4-enoate

Also Known As: Enisoprostum|Enisoprostum [Latin]|Enisoprost [USAN:INN]|ENISOPROST [INN]|Enisoprost (USAN/INN)|ENISOPROST [USAN]|ENISOPROST [MART.]|SC 34301|N921|11,16-dihydroxy-16-methyl-9-oxoprost-4,13-dien-1-oic acid|methyl (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E)-4-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]hept-4-enoate|(+-)-Methyl (Z)-7-((1R,2R,3R)-3-hydroxy-2-((E)-(4RS)-4-hydroxy-4-methyl-1-octenyl)-5-oxocyclopentyl)-4-heptenoate|methyl (Z)-7-((1R,2R,3R)-3-hydroxy-2-((E)-4-hydroxy-4-methyloct-1-en-1-yl)-5-oxocyclopentyl)hept-4-enoate|Prosta-4,13-dien-1-oic acid, 11,16-dihydroxy-16-methyl-9-oxo-, methyl ester, (4Z,11alpha,13E)-(+-)-|(4Z,13E)-11alpha,16-Dihydroxy-16-methyl-9-oxoprosta-4,13-dien-1-oic acid methyl ester|(+/-)-METHYL (Z)-7-((1R,2R,3R)-3-HYDROXY-2-((E)-(4RS)-4-HYDROXY-4-METHYL-1-OCTENYL)-5-OXOCYCLOPENTYL)-4-HEPTENOATE|methyl (4Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(1E)-4-hydroxy-4-methyloct-1-en-1-yl]-5-oxocyclopentyl]hept-4-enoate|PROSTA-4,13-DIEN-1-OIC ACID, 11,16-DIHYDROXY-16-METHYL-9-OXO-, METHYL ESTER, (4Z,11.ALPHA.,13E)-(+/-)-

Molecular Formula	C22H36O5
Molecular Weight	380.2563 g/mol
LogP	3.7296
Topological Polar Surface Area	83.83 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	12
Exact Mass	380.2563
Monoisotopic Mass	380.2563
Heavy Atoms	27
Complexity	520.7962

Chemical Identifiers

CAS Number	81026-63-3
SMILES	CCCCC(C)(C/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CC/C=C\CCC(=O)OC)O)O